(4S)-5-[2-(4,8-dimethylquinolin-2-yl)sulfanylethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: (4S)-5-[2-(4,8-dimethylquinolin-2-yl)sulfanylethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: (4S)-5-[2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: (4S)-5-[2-[(4,8-dimethyl-2-quinolinyl)thio]-1-oxoethyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: (4S)-5-[2-(4,8-dimethylquinolin-2-yl)sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: (4S)-5-[2-[(4,8-dimethyl-2-quinolyl)thio]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC4=C(C=CC=C4C)C(=C3)C

Isomeric SMILES

C[C@H]1CC(=O)NC2=CC=CC=C2N1C(=O)CSC3=NC4=C(C=CC=C4C)C(=C3)C

InChI

InChI=1S/C23H23N3O2S/c1-14-7-6-8-17-15(2)11-21(25-23(14)17)29-13-22(28)26-16(3)12-20(27)24-18-9-4-5-10-19(18)26/h4-11,16H,12-13H2,1-3H3,(H,24,27)/t16-/m0/s1